1-[2-(2,6-dimethylphenoxy)phenyl]-N-methylmethanamine

C16H19NO — CID 43282630

IUPAC1-[2-(2,6-dimethylphenoxy)phenyl]-N-methylmethanamine
SMILESCNCc1ccccc1Oc1c(C)cccc1C
InChIInChI=1S/C16H19NO/c1-12-7-6-8-13(2)16(12)18-15-10-5-4-9-14(15)11-17-3/h4-10,17H,11H2,1-3H3
InChIKeyDHYYGCHSAHTIEO-UHFFFAOYSA-N
MW241.33 g/mol
LogP3.82
Rot. Bonds4

About 1-[2-(2,6-dimethylphenoxy)phenyl]-N-methylmethanamine

1-[2-(2,6-dimethylphenoxy)phenyl]-N-methylmethanamine (PubChem CID 43282630) has the molecular formula C16H19NO and a molecular weight of 241.33 g/mol. Its IUPAC name is 1-[2-(2,6-dimethylphenoxy)phenyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[2-(2,6-dimethylphenoxy)phenyl]-N-methylmethanamine
PubChem CID43282630
Molecular FormulaC16H19NO
Molecular Weight241.33 g/mol
Exact Mass241.15
IUPAC Name1-[2-(2,6-dimethylphenoxy)phenyl]-N-methylmethanamine
SMILESCNCc1ccccc1Oc1c(C)cccc1C
InChIInChI=1S/C16H19NO/c1-12-7-6-8-13(2)16(12)18-15-10-5-4-9-14(15)11-17-3/h4-10,17H,11H2,1-3H3
InChIKeyDHYYGCHSAHTIEO-UHFFFAOYSA-N
XLogP3.82
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[2-(2,6-dimethylphenoxy)phenyl]methyl]propan-1-amine
CID 43282629
1-[2-(2,3-dichlorophenoxy)phenyl]-N-methylmethanamine
CID 43282384
1-[2-(2-ethylphenoxy)phenyl]-N-methylmethanamine
CID 43283795
1-[2-[(2-methoxyphenyl)methoxy]-3-methylphenyl]-N-methylmethanamine
CID 115952135
1-[2-(difluoromethoxy)-3-methylphenyl]-N-methylmethanamine
CID 112608407
N-methyl-1-[3-methyl-2-(pyrimidin-2-ylmethoxy)phenyl]methanamine
CID 112608398
2-methyl-4-[2-(methylaminomethyl)phenoxy]benzonitrile
CID 106485293
2-[2-methyl-6-(methylaminomethyl)phenoxy]acetonitrile
CID 112608438
N-methyl-1-[2-[2-(trifluoromethyl)phenoxy]phenyl]methanamine
CID 43282524
1-[2-(6-ethoxy-2-methylpyrimidin-4-yl)oxyphenyl]-N-methylmethanamine
CID 106485522
1-[2-(cyclopentylmethoxy)-3-methylphenyl]-N-methylmethanamine
CID 112608312
1-[2-methyl-6-(methylaminomethyl)phenoxy]propan-2-ol
CID 112608228

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2,6-dimethylphenoxy)phenyl]-N-methylmethanamine?
The IUPAC name of 1-[2-(2,6-dimethylphenoxy)phenyl]-N-methylmethanamine (CID 43282630) is 1-[2-(2,6-dimethylphenoxy)phenyl]-N-methylmethanamine.
What is the SMILES notation for 1-[2-(2,6-dimethylphenoxy)phenyl]-N-methylmethanamine?
The canonical SMILES for 1-[2-(2,6-dimethylphenoxy)phenyl]-N-methylmethanamine is CNCc1ccccc1Oc1c(C)cccc1C.
What is the InChIKey of 1-[2-(2,6-dimethylphenoxy)phenyl]-N-methylmethanamine?
The InChIKey is DHYYGCHSAHTIEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO/c1-12-7-6-8-13(2)16(12)18-15-10-5-4-9-14(15)11-17-3/h4-10,17H,11H2,1-3H3.
What are the key properties of 1-[2-(2,6-dimethylphenoxy)phenyl]-N-methylmethanamine?
1-[2-(2,6-dimethylphenoxy)phenyl]-N-methylmethanamine has a molecular weight of 241.33 g/mol, XLogP of 3.82, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2,6-dimethylphenoxy)phenyl]-N-methylmethanamine is sourced from PubChem (CID 43282630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).